Bromide

Bromide

SCHEMBL1508970

Clc1ccc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1Cl.[Br-]

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.51
SIGMAR1 Q99720 3/20 0.46
PNMT P11086 2/20 0.46
IDO1 P14902 3/20 0.44
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
PLA2G1B P04054 1/20 0.42
POLB P06746 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KMO O15229 1/20 0.41
HIF1A Q16665 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL7338415 0.96 SNCA (0.49) SNCASIGMAR1PNMTIDO1SLC6A2
Bromide SCHEMBL1508663 0.84 SNCA (0.47) SNCASLC6A2SLC6A4SLC6A3PLA2G1B
Bromide SCHEMBL1508860 0.84 SNCA (0.47) SNCASIGMAR1SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL8424236 0.81 SNCA (0.45) SNCASIGMAR1PNMTMAPK1HIF1A
Bromide SCHEMBL10721589 0.80 MEN1 (0.47) SNCAALDH1A1
Bromide SCHEMBL7084184 0.80 SNCA (0.44) SNCA
Bromide SCHEMBL10655438 0.80 SNCA (0.47) SNCAPLA2G1BPOLBATG4BTDP1
Hydrochloric Acid SCHEMBL9303546 0.80 PNMT (0.49) SIGMAR1PNMTIDO1SLC6A2SLC6A4
Bromide SCHEMBL39844 0.80 SNCA (0.73) SNCASIGMAR1SLC6A2SLC6A4SLC6A3
Bromide SCHEMBL4171166 0.79 SNCA (0.61) SNCASIGMAR1IDO1SLC6A2SLC6A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10266481-B2 Organocatalytic asymmetric synthesis of antidepressants COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2019-04-23 US disclosed
US-20170158607-A1 ORGANOCATALYTIC ASYMMETRIC SYNTHESIS OF ANTIDEPRESSANTS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-06-08 US disclosed
WO-2015193921-A1 AN ORGANOCATALYTIC ASYMMETRIC SYNTHESIS OF ANTIDEPRESSANTS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-12-23 WO disclosed
EP-2298778-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING 4,7-DIAZASPIROÝ2.5¨OCTANE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2011-03-23 EP disclosed
EP-1131290-B1 PIPERIDINE CCR-3 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2008-02-20 EP disclosed
EP-1680408-A2 CCR3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-07-19 EP disclosed
US-6984637-B2 Cyclic amine derivatives-CCR-3 receptor antagonists SYNTEX (U.S.A.) LLC (US) 2006-01-10 US disclosed
EP-0903349-B1 CCR-3 receptor antagonists HOFFMANN LA ROCHE (CH) 2006-01-04 EP disclosed
WO-2005040129-A2 CCR3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-05-06 WO disclosed
US-20050090504-A1 Piperidinyl and piperazinyl compounds substituted with bicyclo-heterocyclylalkyl groups useful as CCR3 receptor antagonists ROCHE PALO ALTO LLC 2005-04-28 US disclosed
EP-1131291-A1 4-AROYL-PIPERIDIN-CCR-3 RECEPTOR ANTAGONISTS III F. HOFFMANN-LA ROCHE AG (CH) 2001-09-12 EP disclosed
US-6140344-A FOR TREATING PATHOLOGICAL CONDITIONS SUCH AS ASTHMA, RHINITIS, ECZEMA AND PARASITIC INFECTIONS FEATURING TISSUE EOSINOPHILIA SYNTEX (U.S.A.) INC. (US) 2000-10-31 US disclosed
WO-2000031033-A1 PIPERIDINE CCR-3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2000-06-02 WO disclosed
WO-2000029377-A1 4-AROYL-PIPERIDIN-CCR-3 RECEPTOR ANTAGONISTS III F. HOFFMANN-LA ROCHE AG (CH) 2000-05-25 WO disclosed
US-6011181-A REDUCING THE LEVEL OF TRI-SUBSTITUTED PHOSPHINE, ARSINE AND/OR STIBINE OXIDE FROM A MIXTURE COMPRISING THE ADDITION OF A METAL SALT TO THE MIXTURE TO FORM A COMPLEX WITH THE OXIDE, AND REMOVING THE COMPLEX BASF AKTIENGESELLSCHAFT (DE) 2000-01-04 US disclosed
EP-0949238-A1 SUBSTITUTED PROPIONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-10-13 EP disclosed
EP-0903349-A2 CCR-3 receptor antagonists F. HOFFMANN-LA ROCHE AG (CH) 1999-03-24 EP disclosed
EP-0850902-A1 Process for reducing the level of trisubstituted phosphine, arsine and/or stibine oxide in a mixture BASF AKTIENGESELLSCHAFT (DE) 1998-07-01 EP disclosed
US-5242945-A Antiinflammatory AMERICAN HOME PRODUCTS CORPORATION (US) 1993-09-07 US disclosed
EP-0508690-A1 Tetronic and thiotetronic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1992-10-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10266481-B2 Organocatalytic asymmetric synthesis of antidepressants TPH1, NAT1, TPH2 SNCA 581/4885SIGMAR1 22/4885PNMT 9/4885
US-20050090504-A1 Piperidinyl and piperazinyl compounds substituted with bicyclo-heterocyclylalkyl groups useful as CCR3 receptor antagonists CCR9, CCR3, CCR1 SNCA 4450/4885SIGMAR1 589/4885PNMT 3017/4885
US-20170158607-A1 ORGANOCATALYTIC ASYMMETRIC SYNTHESIS OF ANTIDEPRESSANTS TPH1, NAT1, TPH2 SNCA 581/4885SIGMAR1 22/4885PNMT 9/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.